N-methyl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]pentan-1-amine

C15H32N2O — CID 55074744

IUPACN-methyl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]pentan-1-amine
SMILESCCCCCN(C)CC1CCC(CNCCC)O1
InChIInChI=1S/C15H32N2O/c1-4-6-7-11-17(3)13-15-9-8-14(18-15)12-16-10-5-2/h14-16H,4-13H2,1-3H3
InChIKeyZNZVGSDQGXIVPM-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.66
Rot. Bonds10

About N-methyl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]pentan-1-amine

N-methyl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]pentan-1-amine (PubChem CID 55074744) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is N-methyl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]pentan-1-amine.

Molecular Properties

Compound NameN-methyl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]pentan-1-amine
PubChem CID55074744
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC NameN-methyl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]pentan-1-amine
SMILESCCCCCN(C)CC1CCC(CNCCC)O1
InChIInChI=1S/C15H32N2O/c1-4-6-7-11-17(3)13-15-9-8-14(18-15)12-16-10-5-2/h14-16H,4-13H2,1-3H3
InChIKeyZNZVGSDQGXIVPM-UHFFFAOYSA-N
XLogP2.66
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[[5-[[methyl(2-methylsulfonylethyl)amino]methyl]oxolan-2-yl]methyl]propan-1-amine
CID 79858503
N-[[5-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-1-amine
CID 63234318
N-[[5-[[cyclopropylmethyl(propyl)amino]methyl]oxolan-2-yl]methyl]propan-1-amine
CID 62431296
N-butan-2-yl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]butan-1-amine
CID 62412291
N,N-dimethyl-N'-propyl-N'-[[5-(propylaminomethyl)oxolan-2-yl]methyl]ethane-1,2-diamine
CID 62436901
N-[[5-[[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]methyl]oxolan-2-yl]methyl]propan-1-amine
CID 63683736
N'-(cyclopentylmethyl)-N'-methyl-N-propylbutane-1,4-diamine
CID 63657735
N-[[5-[[propan-2-yl(propyl)amino]methyl]oxolan-2-yl]methyl]propan-1-amine
CID 55074978
2-methyl-N-[[5-[[methyl(propyl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine
CID 62417002
N'-methyl-N'-(oxolan-2-ylmethyl)-N-propylbutane-1,4-diamine
CID 62435535
N-(cyclopentylmethyl)-N'-methyl-N'-pentylethane-1,2-diamine
CID 62561686
N-[[5-(butoxymethyl)oxolan-2-yl]methyl]propan-1-amine
CID 62450434

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]pentan-1-amine?
The IUPAC name of N-methyl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]pentan-1-amine (CID 55074744) is N-methyl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]pentan-1-amine.
What is the SMILES notation for N-methyl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]pentan-1-amine?
The canonical SMILES for N-methyl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]pentan-1-amine is CCCCCN(C)CC1CCC(CNCCC)O1.
What is the InChIKey of N-methyl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]pentan-1-amine?
The InChIKey is ZNZVGSDQGXIVPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-4-6-7-11-17(3)13-15-9-8-14(18-15)12-16-10-5-2/h14-16H,4-13H2,1-3H3.
What are the key properties of N-methyl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]pentan-1-amine?
N-methyl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]pentan-1-amine has a molecular weight of 256.43 g/mol, XLogP of 2.66, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[5-(propylaminomethyl)oxolan-2-yl]methyl]pentan-1-amine is sourced from PubChem (CID 55074744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).